OC000459

Ligand id: 9277

Name: OC000459

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 4
Hydrogen bond donors 1
Rotatable bonds 4
Topological polar surface area 55.12
Molecular weight 348.13
XLogP 5.26
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
2-[5-fluoro-2-methyl-3-(quinolin-2-ylmethyl)indol-1-yl]acetic acid
Database Links
ChEMBL Ligand CHEMBL560993
PubChem CID 11462174
Search Google for chemical match using the InChIKey FATGTHLOZSXOBC-UHFFFAOYSA-N
Search Google for chemicals with the same backbone FATGTHLOZSXOBC
Search UniChem for chemical match using the InChIKey FATGTHLOZSXOBC-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone FATGTHLOZSXOBC
Comments
OC000459 is a potent, selective, and orally active DP2 receptor antagonist [1-2].